N-[6-tert-butyl-3-[(3-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-4-carboxamide

Systemtic Name: N-[6-tert-butyl-3-[(3-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-4-carboxamide Openeye Name: N-[6-tert-butyl-3-[(3-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]pyridine-4-carboxamide CAS Name: N-[6-tert-butyl-3-[(3-chloroanilino)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-pyridinecarboxamide IUPAC Name: N-[6-tert-butyl-3-[(3-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-4-carboxamide Traditional Name: N-[6-tert-butyl-3-[(3-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]isonicotinamide Formula: C25H26ClN3O2S MolecularWeight: 468.01084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3=CC(=CC=C3)Cl)NC(=O)C4=CC=NC=C4

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3=CC(=CC=C3)Cl)NC(=O)C4=CC=NC=C4

InChI

InChI=1S/C25H26ClN3O2S/c1-25(2,3)16-7-8-19-20(13-16)32-24(29-22(30)15-9-11-27-12-10-15)21(19)23(31)28-18-6-4-5-17(26)14-18/h4-6,9-12,14,16H,7-8,13H2,1-3H3,(H,28,31)(H,29,30)